orbital_charges     :real:2:9,11
  0.645630008894871E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.174344996192943E+001  0.196401853514960E+001  0.122841463986195E+001
  0.160680418845182E+001  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.122011025677609E+001  0.964716006065900E+000  0.778690058366551E+000
  0.969219873066401E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.938488339048502E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.969573869661291E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.969567517003424E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.191537174072575E+001  0.198762895373041E+001  0.188097561900921E+001
  0.140542255858655E+001 -0.861805200293514E-003 -0.130816147294761E-002
 -0.304951292035165E-002 -0.233334094849239E-001 -0.308480044854833E-001
  0.129256108011789E+001  0.101206507438734E+001  0.969588020885428E+000
  0.804094889810374E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.938603841393898E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.927206183652216E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.927199676989121E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,11
  0.437276820496046E-004  0.145192749027134E-005 -0.388478221572813E-004
 -0.480873893133893E-004 -0.114713669055638E-005  0.340210117187358E-004
  0.469625769975047E-004 -0.221396878246001E-005  0.395248700429830E-004
  0.123621718111089E-004  0.629632808478706E-006 -0.250093597413403E-004
 -0.316368770273343E-004  0.369869458313743E-004  0.564141423248926E-005
 -0.304180906963783E-004 -0.357104354715004E-004  0.510222865604884E-005
 -0.405182549848004E-004 -0.635729639664511E-007 -0.179502568742503E-004
  0.193377126281591E-004  0.305543756590751E-006 -0.178983695492858E-004
  0.341693319300118E-005  0.385003326222258E-007  0.158041603642439E-004
  0.123763098171820E-004  0.189711796715064E-005 -0.133853678543905E-006
  0.124772255253695E-004 -0.217455427799218E-005 -0.254023013832039E-006
mermin_energy       :real:0:
 -0.125377284134473E+002
end_coords          :real:2:3,11
  0.279760415399113E+001 -0.715091211338150E-003 -0.852047439401538E+000
  0.122750437821638E+001 -0.191523728942474E-003  0.784893342986482E-001
  0.172712360882318E+001  0.932012857567125E-004  0.268747955942452E+001
 -0.727582111150058E-001  0.719607656450854E-004  0.370290590478503E+001
  0.281426520662834E+001 -0.168767368908560E+001  0.325756225018661E+001
  0.281405661867372E+001  0.168809468224134E+001  0.325726588445982E+001
  0.266966911874928E+001  0.111777292224443E-003 -0.711861573247644E+001
 -0.461657621263306E+000  0.557658139229640E-004 -0.578029538454326E+001
 -0.181614812771363E+001  0.161307010385097E-003 -0.730271374535227E+001
 -0.682249115362101E+000 -0.167029565551107E+001 -0.463579466924512E+001
 -0.682220467116114E+000  0.167026615688839E+001 -0.463558239632483E+001
